N-(4-bromanyl-2-methyl-phenyl)-1-chloranyl-benzo[e][1]benzothiole-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-chloranyl-benzo[e][1]benzothiole-2-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-chloro-benzo[e]benzothiophene-2-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-chloro-2-benzo[e][1]benzothiolecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-1-chlorobenzo[e][1]benzothiole-2-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-chloro-benzo[e]benzothiophene-2-carboxamide Formula: C20H13BrClNOS MolecularWeight: 430.74532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C20H13BrClNOS/c1-11-10-13(21)7-8-15(11)23-20(24)19-18(22)17-14-5-3-2-4-12(14)6-9-16(17)25-19/h2-10H,1H3,(H,23,24)